SCHEMBL25934140

SCHEMBL25934140

Cn1c(=O)n(C2CCC(=O)NC2=O)c2cccc(CN3CC4(CCN(CC5CCNCC5)CC4)C3)c21

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 16/20 0.47
DDB1 Q16531 15/20 0.47
IRAK4 Q9NWZ3 1/20 0.33
IKZF1 Q13422 1/20 0.33
IKZF2 Q9UKS7 1/20 0.33
USP2 O75604 1/20 0.32
CYP2D6 P10635 1/20 0.32
IKZF3 Q9UKT9 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL31701106 0.92 CRBN (0.52) CRBNDDB1IRAK4IKZF1IKZF2
SCHEMBL26098283 0.91 DDB1 (0.46) CRBNDDB1IRAK4IKZF1IKZF2
SCHEMBL26098278 0.91 DDB1 (0.46) CRBNDDB1IRAK4IKZF1IKZF2
SCHEMBL21997445 0.90 DDB1 (0.53) CRBNDDB1USP2CYP2D6IKZF3
SCHEMBL31700697 0.88 DDB1 (0.51) CRBNDDB1IRAK4IKZF1IKZF2
SCHEMBL21996775 0.87 CRBN (0.53) CRBNDDB1USP2CYP2D6IKZF3
Trifluoroacetic Acid SCHEMBL30392458 0.86 CRBN (0.41) CRBNDDB1IRAK4IKZF1IKZF2
SCHEMBL23842385 0.85 DDB1 (0.47) CRBNDDB1
SCHEMBL21070862 0.85 CRBN (0.52) CRBNDDB1IKZF2IKZF3
SCHEMBL26634965 0.85 CRBN (0.52) CRBNDDB1IKZF1IKZF2IKZF3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023109892-A1 COMPOUND FOR INHIBITING OR DEGRADING BRD9, AND COMPOSITION AND PHARMACEUTICAL USE THEREOF 海思科医药集团股份有限公司 2023-06-22 WO disclosed